# generated using pymatgen
data_Al162H485
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   17.23927908
_cell_length_b   17.23868843
_cell_length_c   21.11358895
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al162H485
_chemical_formula_sum   'Al162 H485'
_cell_volume   5433.95471308
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Al  Al1  1  1.001462  0.007600  0.152274  1
  Al  Al2  1  1.002975  0.006137  0.485487  1
  Al  Al3  1  1.002969  0.006159  0.819083  1
  Al  Al4  1  0.671386  0.337442  0.152502  1
  Al  Al5  1  0.669729  0.339376  0.485519  1
  Al  Al6  1  0.669750  0.339361  0.818991  1
  Al  Al7  1  0.336428  0.672656  0.152245  1
  Al  Al8  1  0.336329  0.672781  0.485538  1
  Al  Al9  1  0.336356  0.672756  0.818984  1
  Al  Al10  1  0.336148  0.006120  0.152233  1
  Al  Al11  1  0.336329  0.006098  0.485530  1
  Al  Al12  1  0.336339  0.006085  0.818966  1
  Al  Al13  1  1.002861  0.338943  0.152071  1
  Al  Al14  1  1.002994  0.339420  0.485508  1
  Al  Al15  1  1.003020  0.339415  0.818948  1
  Al  Al16  1  0.669729  0.672652  0.152249  1
  Al  Al17  1  0.669691  0.672773  0.485557  1
  Al  Al18  1  0.669709  0.672741  0.818984  1
  Al  Al19  1  0.669661  0.006246  0.152228  1
  Al  Al20  1  0.669714  0.006138  0.485492  1
  Al  Al21  1  0.669776  0.006121  0.819014  1
  Al  Al22  1  0.336358  0.339345  0.152198  1
  Al  Al23  1  0.336348  0.339418  0.485520  1
  Al  Al24  1  0.336378  0.339412  0.818941  1
  Al  Al25  1  1.003001  0.672800  0.152213  1
  Al  Al26  1  1.002996  0.672829  0.485510  1
  Al  Al27  1  0.003033  0.672844  0.818977  1
  Al  Al28  1  1.002816  0.007290  -0.013184  1
  Al  Al29  1  1.002646  0.006515  0.318517  1
  Al  Al30  1  1.003013  0.006109  0.652264  1
  Al  Al31  1  0.670064  0.338975  -0.014032  1
  Al  Al32  1  0.669699  0.339328  0.318805  1
  Al  Al33  1  0.669704  0.339412  0.652260  1
  Al  Al34  1  0.336378  0.672701  -0.014344  1
  Al  Al35  1  0.336350  0.672749  0.318840  1
  Al  Al36  1  0.336346  0.672769  0.652257  1
  Al  Al37  1  0.336251  0.006109  -0.014331  1
  Al  Al38  1  0.336273  0.006100  0.318834  1
  Al  Al39  1  0.336356  0.006092  0.652256  1
  Al  Al40  1  1.003015  0.339252  -0.014417  1
  Al  Al41  1  0.003025  0.339375  0.318827  1
  Al  Al42  1  1.003023  0.339427  0.652241  1
  Al  Al43  1  0.669754  0.672630  -0.014332  1
  Al  Al44  1  0.669704  0.672728  0.318864  1
  Al  Al45  1  0.669701  0.672770  0.652267  1
  Al  Al46  1  0.669759  1.006081  -0.014385  1
  Al  Al47  1  0.669784  0.006151  0.318781  1
  Al  Al48  1  0.669718  0.006111  0.652262  1
  Al  Al49  1  0.336382  0.339386  -0.014394  1
  Al  Al50  1  0.336338  0.339376  0.318829  1
  Al  Al51  1  0.336364  0.339424  0.652233  1
  Al  Al52  1  1.003023  0.672826  -0.014376  1
  Al  Al53  1  1.002963  0.672871  0.318814  1
  Al  Al54  1  1.003015  0.672811  0.652249  1
  Al  Al55  1  0.113762  0.117126  0.262963  1
  Al  Al56  1  0.114122  0.117202  0.596671  1
  Al  Al57  1  0.114128  0.117114  0.930126  1
  Al  Al58  1  0.780812  0.450354  0.263347  1
  Al  Al59  1  0.780804  0.450537  0.596690  1
  Al  Al60  1  0.780802  0.450486  0.930103  1
  Al  Al61  1  0.447444  0.783855  0.263325  1
  Al  Al62  1  0.447462  0.783875  0.596697  1
  Al  Al63  1  0.447489  0.783801  0.930102  1
  Al  Al64  1  0.447448  0.117166  0.263275  1
  Al  Al65  1  0.447480  0.117202  0.596673  1
  Al  Al66  1  0.447477  0.117185  0.930090  1
  Al  Al67  1  0.114073  0.450470  0.263263  1
  Al  Al68  1  0.114125  0.450558  0.596663  1
  Al  Al69  1  0.114123  0.450518  0.930066  1
  Al  Al70  1  0.780803  0.783936  0.263306  1
  Al  Al71  1  0.780812  0.783912  0.596682  1
  Al  Al72  1  0.780863  0.783921  0.930116  1
  Al  Al73  1  0.781011  0.118193  0.262114  1
  Al  Al74  1  0.780814  0.117208  0.596667  1
  Al  Al75  1  0.781181  0.117248  0.930413  1
  Al  Al76  1  0.447575  0.450447  0.263261  1
  Al  Al77  1  0.447471  0.450534  0.596674  1
  Al  Al78  1  0.447554  0.450459  0.930097  1
  Al  Al79  1  0.114067  0.783928  0.263315  1
  Al  Al80  1  0.114109  0.783916  0.596669  1
  Al  Al81  1  0.114043  0.784021  0.930149  1
  Al  Al82  1  0.112441  0.116915  0.096429  1
  Al  Al83  1  0.114077  0.117197  0.429939  1
  Al  Al84  1  0.114098  0.117191  0.763411  1
  Al  Al85  1  0.780966  0.449890  0.096860  1
  Al  Al86  1  0.780807  0.450522  0.429982  1
  Al  Al87  1  0.780833  0.450500  0.763422  1
  Al  Al88  1  0.447468  0.783790  0.096732  1
  Al  Al89  1  0.447449  0.783876  0.429990  1
  Al  Al90  1  0.447479  0.783852  0.763410  1
  Al  Al91  1  0.447398  0.117171  0.096686  1
  Al  Al92  1  0.447471  0.117198  0.429947  1
  Al  Al93  1  0.447498  0.117197  0.763392  1
  Al  Al94  1  0.114097  0.450468  0.096681  1
  Al  Al95  1  0.114118  0.450537  0.429947  1
  Al  Al96  1  0.114136  0.450550  0.763373  1
  Al  Al97  1  0.780825  0.783888  0.096717  1
  Al  Al98  1  0.780793  0.783964  0.429954  1
  Al  Al99  1  0.780831  0.783912  0.763420  1
  Al  Al100  1  0.782363  0.117148  0.096657  1
  Al  Al101  1  0.780857  0.117215  0.429848  1
  Al  Al102  1  0.780852  0.117199  0.763444  1
  Al  Al103  1  0.447678  0.450355  0.096698  1
  Al  Al104  1  0.447487  0.450511  0.429965  1
  Al  Al105  1  0.447497  0.450514  0.763400  1
  Al  Al106  1  0.114166  0.783994  0.096702  1
  Al  Al107  1  0.114050  0.783984  0.429916  1
  Al  Al108  1  0.114113  0.783938  0.763439  1
  Al  Al109  1  0.891348  0.227827  0.042180  1
  Al  Al110  1  0.891796  0.228378  0.374327  1
  Al  Al111  1  0.891912  0.228298  0.707843  1
  Al  Al112  1  0.558782  0.561328  0.041255  1
  Al  Al113  1  0.558606  0.561607  0.374400  1
  Al  Al114  1  0.558591  0.561627  0.707845  1
  Al  Al115  1  0.225163  0.895054  0.041138  1
  Al  Al116  1  0.225183  0.895027  0.374387  1
  Al  Al117  1  0.225217  0.894999  0.707850  1
  Al  Al118  1  0.225081  0.228261  0.041180  1
  Al  Al119  1  0.225172  0.228271  0.374350  1
  Al  Al120  1  0.225252  0.228307  0.707807  1
  Al  Al121  1  0.891935  0.561586  0.041171  1
  Al  Al122  1  0.891899  0.561635  0.374399  1
  Al  Al123  1  0.891919  0.561675  0.707822  1
  Al  Al124  1  0.558578  0.894973  0.041179  1
  Al  Al125  1  0.558578  0.895000  0.374419  1
  Al  Al126  1  0.558599  0.894987  0.707839  1
  Al  Al127  1  0.558679  0.228218  0.041256  1
  Al  Al128  1  0.558686  0.228237  0.374362  1
  Al  Al129  1  0.558617  0.228301  0.707831  1
  Al  Al130  1  0.225249  0.561641  0.041152  1
  Al  Al131  1  0.225210  0.561665  0.374401  1
  Al  Al132  1  0.225238  0.561673  0.707815  1
  Al  Al133  1  0.892083  0.895432  0.041308  1
  Al  Al134  1  0.891832  0.895223  0.374271  1
  Al  Al135  1  0.891948  0.895024  0.707872  1
  Al  Al136  1  0.892478  0.227262  0.206750  1
  Al  Al137  1  0.891915  0.228297  0.541087  1
  Al  Al138  1  0.892031  0.228260  0.874603  1
  Al  Al139  1  0.558746  0.561428  0.207750  1
  Al  Al140  1  0.558574  0.561646  0.541124  1
  Al  Al141  1  0.558655  0.561529  0.874580  1
  Al  Al142  1  0.225148  0.894984  0.207675  1
  Al  Al143  1  0.225209  0.895004  0.541100  1
  Al  Al144  1  0.225141  0.895010  0.874569  1
  Al  Al145  1  0.225045  0.228196  0.207676  1
  Al  Al146  1  0.225235  0.228305  0.541086  1
  Al  Al147  1  0.225221  0.228300  0.874530  1
  Al  Al148  1  0.891892  0.561608  0.207759  1
  Al  Al149  1  0.891907  0.561680  0.541109  1
  Al  Al150  1  0.891928  0.561621  0.874531  1
  Al  Al151  1  0.558578  0.894976  0.207778  1
  Al  Al152  1  0.558588  0.894998  0.541116  1
  Al  Al153  1  0.558617  0.894961  0.874529  1
  Al  Al154  1  0.558663  0.228304  0.207793  1
  Al  Al155  1  0.558609  0.228303  0.541080  1
  Al  Al156  1  0.558643  0.228296  0.874544  1
  Al  Al157  1  0.225248  0.561638  0.207751  1
  Al  Al158  1  0.225228  0.561673  0.541091  1
  Al  Al159  1  0.225249  0.561664  0.874511  1
  Al  Al160  1  0.891743  0.895603  0.207622  1
  Al  Al161  1  0.891878  0.895059  0.541058  1
  Al  Al162  1  0.891995  0.895141  0.874660  1
  H  H163  1  0.891908  0.145009  0.457661  1
  H  H164  1  0.891917  0.145005  0.791269  1
  H  H165  1  0.559573  0.477249  0.124510  1
  H  H166  1  0.558597  0.478293  0.457759  1
  H  H167  1  0.558619  0.478265  0.791216  1
  H  H168  1  0.225318  0.811570  0.124447  1
  H  H169  1  0.225173  0.811707  0.457739  1
  H  H170  1  0.225242  0.811663  0.791201  1
  H  H171  1  0.224253  0.144909  0.124420  1
  H  H172  1  0.225206  0.144972  0.457714  1
  H  H173  1  0.225228  0.144977  0.791171  1
  H  H174  1  0.891913  0.478129  0.124465  1
  H  H175  1  0.891901  0.478330  0.457759  1
  H  H176  1  0.891924  0.478318  0.791171  1
  H  H177  1  0.558599  0.811583  0.124476  1
  H  H178  1  0.558571  0.811667  0.457770  1
  H  H179  1  0.558605  0.811635  0.791188  1
  H  H180  1  0.558507  0.144976  0.124484  1
  H  H181  1  0.558584  0.144992  0.457730  1
  H  H182  1  0.558652  0.144967  0.791192  1
  H  H183  1  0.225226  0.478269  0.124454  1
  H  H184  1  0.225220  0.478327  0.457742  1
  H  H185  1  0.225255  0.478325  0.791160  1
  H  H186  1  0.891913  0.811801  0.124465  1
  H  H187  1  0.891929  0.811751  0.457666  1
  H  H188  1  0.891897  0.811767  0.791264  1
  H  H189  1  0.029957  0.200174  0.013269  1
  H  H190  1  0.030770  0.200455  0.346562  1
  H  H191  1  0.030802  0.200523  0.680035  1
  H  H192  1  0.697619  0.533614  0.013538  1
  H  H193  1  0.697482  0.533842  0.346649  1
  H  H194  1  0.697491  0.533858  0.680061  1
  H  H195  1  0.364120  0.867193  0.013431  1
  H  H196  1  0.364089  0.867210  0.346641  1
  H  H197  1  0.364129  0.867199  0.680058  1
  H  H198  1  0.364036  0.200510  0.013377  1
  H  H199  1  0.364103  0.200499  0.346614  1
  H  H200  1  0.364154  0.200526  0.680031  1
  H  H201  1  0.030786  0.533876  0.013380  1
  H  H202  1  0.030781  0.533909  0.346612  1
  H  H203  1  0.030806  0.533897  0.680024  1
  H  H204  1  0.697480  0.867219  0.013409  1
  H  H205  1  0.697465  0.867288  0.346627  1
  H  H206  1  0.697493  0.867217  0.680047  1
  H  H207  1  0.697565  0.200360  0.013556  1
  H  H208  1  0.697696  0.200285  0.346317  1
  H  H209  1  0.697514  0.200510  0.680054  1
  H  H210  1  0.364206  0.533788  0.013417  1
  H  H211  1  0.364146  0.533829  0.346612  1
  H  H212  1  0.364146  0.533864  0.680040  1
  H  H213  1  0.030881  0.867772  0.013603  1
  H  H214  1  0.030670  0.867493  0.346542  1
  H  H215  1  0.030816  0.867226  0.680061  1
  H  H216  1  0.252493  0.006441  0.068967  1
  H  H217  1  0.252957  0.006131  0.402167  1
  H  H218  1  0.253010  0.006101  0.735613  1
  H  H219  1  0.919674  0.339179  0.068817  1
  H  H220  1  0.919654  0.339412  0.402104  1
  H  H221  1  0.919700  0.339418  0.735602  1
  H  H222  1  0.586386  0.672622  0.068962  1
  H  H223  1  0.586355  0.672752  0.402211  1
  H  H224  1  0.586379  0.672748  0.735622  1
  H  H225  1  0.586388  0.006164  0.068915  1
  H  H226  1  0.586384  0.006138  0.402137  1
  H  H227  1  0.586418  0.006085  0.735641  1
  H  H228  1  0.252984  0.339345  0.068905  1
  H  H229  1  0.253010  0.339375  0.402170  1
  H  H230  1  0.253035  0.339426  0.735588  1
  H  H231  1  0.919671  0.672798  0.068911  1
  H  H232  1  0.919670  0.672792  0.402172  1
  H  H233  1  0.919708  0.672805  0.735621  1
  H  H234  1  0.919278  0.007627  0.069482  1
  H  H235  1  0.919671  0.006259  0.402057  1
  H  H236  1  0.919734  0.006109  0.735663  1
  H  H237  1  0.586877  0.338871  0.069282  1
  H  H238  1  0.586414  0.339340  0.402188  1
  H  H239  1  0.586396  0.339406  0.735622  1
  H  H240  1  0.253047  0.672714  0.068950  1
  H  H241  1  0.252988  0.672789  0.402186  1
  H  H242  1  0.253010  0.672791  0.735620  1
  H  H243  1  0.754577  0.254936  0.069492  1
  H  H244  1  0.753003  0.256053  0.402066  1
  H  H245  1  0.753038  0.256082  0.735628  1
  H  H246  1  0.419904  0.589230  0.068988  1
  H  H247  1  0.419686  0.589420  0.402190  1
  H  H248  1  0.419690  0.589429  0.735623  1
  H  H249  1  0.086226  0.923565  0.069516  1
  H  H250  1  0.086139  0.922930  0.401990  1
  H  H251  1  0.086315  0.922839  0.735670  1
  H  H252  1  0.086078  0.255586  0.068791  1
  H  H253  1  0.086312  0.256072  0.402170  1
  H  H254  1  0.086357  0.256083  0.735596  1
  H  H255  1  0.753095  0.589060  0.068965  1
  H  H256  1  0.753028  0.589422  0.402212  1
  H  H257  1  0.753033  0.589421  0.735619  1
  H  H258  1  0.419600  0.922745  0.068949  1
  H  H259  1  0.419662  0.922771  0.402188  1
  H  H260  1  0.419689  0.922756  0.735617  1
  H  H261  1  0.419695  0.256024  0.068907  1
  H  H262  1  0.419727  0.256083  0.402178  1
  H  H263  1  0.419708  0.256087  0.735592  1
  H  H264  1  0.086353  0.589411  0.068921  1
  H  H265  1  0.086302  0.589475  0.402165  1
  H  H266  1  0.086343  0.589470  0.735608  1
  H  H267  1  0.753135  0.922780  0.068955  1
  H  H268  1  0.753067  0.922920  0.402122  1
  H  H269  1  0.753047  0.922803  0.735629  1
  H  H270  1  0.995418  0.093211  0.072725  1
  H  H271  1  1.002912  0.089466  0.402092  1
  H  H272  1  1.002990  0.089417  0.735658  1
  H  H273  1  0.669807  0.422226  0.069325  1
  H  H274  1  0.669703  0.422709  0.402178  1
  H  H275  1  0.669716  0.422723  0.735628  1
  H  H276  1  0.336352  0.756070  0.068936  1
  H  H277  1  0.336320  0.756113  0.402189  1
  H  H278  1  0.336359  0.756082  0.735618  1
  H  H279  1  0.336171  0.089459  0.068983  1
  H  H280  1  0.336295  0.089428  0.402171  1
  H  H281  1  0.336370  0.089414  0.735608  1
  H  H282  1  1.003010  0.422590  0.068927  1
  H  H283  1  1.003016  0.422746  0.402173  1
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  H  H574  1  0.308550  0.811676  0.624477  1
  H  H575  1  0.308540  0.811606  0.957847  1
  H  H576  1  0.308510  0.144952  0.291025  1
  H  H577  1  0.308575  0.144983  0.624452  1
  H  H578  1  0.308509  0.144952  0.957874  1
  H  H579  1  0.975215  0.478281  0.291073  1
  H  H580  1  0.975237  0.478338  0.624459  1
  H  H581  1  0.975242  0.478221  0.957842  1
  H  H582  1  0.641928  0.811650  0.291100  1
  H  H583  1  0.641922  0.811672  0.624475  1
  H  H584  1  0.641954  0.811585  0.957861  1
  H  H585  1  0.642368  0.144959  0.290987  1
  H  H586  1  0.641924  0.144993  0.624455  1
  H  H587  1  0.642041  0.144983  0.957869  1
  H  H588  1  0.308615  0.478283  0.291079  1
  H  H589  1  0.308567  0.478333  0.624452  1
  H  H590  1  0.308617  0.478289  0.957837  1
  H  H591  1  0.975080  0.811893  0.290954  1
  H  H592  1  0.975206  0.811720  0.624452  1
  H  H593  1  0.975266  0.811793  0.957977  1
  H  H594  1  0.892238  0.311167  0.290638  1
  H  H595  1  0.891914  0.311628  0.624465  1
  H  H596  1  0.891590  0.311491  0.958293  1
  H  H597  1  0.558620  0.644910  0.291067  1
  H  H598  1  0.558585  0.644973  0.624486  1
  H  H599  1  0.558643  0.644835  0.957924  1
  H  H600  1  0.225110  0.978372  0.290997  1
  H  H601  1  0.225236  0.978308  0.624469  1
  H  H602  1  0.225332  0.978243  0.957795  1
  H  H603  1  0.225185  0.311564  0.291007  1
  H  H604  1  0.225242  0.311644  0.624445  1
  H  H605  1  0.225208  0.311616  0.957864  1
  H  H606  1  0.891902  0.645020  0.291064  1
  H  H607  1  0.891914  0.645014  0.624465  1
  H  H608  1  0.891925  0.645009  0.957867  1
  H  H609  1  0.558624  0.978327  0.291077  1
  H  H610  1  0.558601  0.978318  0.624477  1
  H  H611  1  0.558622  0.978292  0.957848  1
  H  H612  1  0.558495  0.311662  0.291135  1
  H  H613  1  0.558592  0.311630  0.624462  1
  H  H614  1  0.558718  0.311568  0.957933  1
  H  H615  1  0.225206  0.645001  0.291083  1
  H  H616  1  0.225227  0.645005  0.624454  1
  H  H617  1  0.225204  0.645037  0.957854  1
  H  H618  1  0.891405  0.979018  0.290901  1
  H  H619  1  0.891914  0.978320  0.624465  1
  H  H620  1  0.892423  0.978509  0.958030  1
  H  H621  1  0.086261  1.006012  0.235374  1
  H  H622  1  0.086312  0.006111  0.568877  1
  H  H623  1  0.086130  1.006068  0.902614  1
  H  H624  1  0.753869  0.338218  0.235662  1
  H  H625  1  0.753024  0.339413  0.568895  1
  H  H626  1  0.753056  0.339313  0.902369  1
  H  H627  1  0.419790  0.672633  0.235553  1
  H  H628  1  0.419672  0.672767  0.568900  1
  H  H629  1  0.419723  0.672690  0.902317  1
  H  H630  1  0.419620  1.006081  0.235514  1
  H  H631  1  0.419680  0.006098  0.568891  1
  H  H632  1  0.419680  1.006062  0.902319  1
  H  H633  1  0.086207  0.339320  0.235393  1
  H  H634  1  0.086335  0.339436  0.568869  1
  H  H635  1  0.086344  0.339411  0.902281  1
  H  H636  1  0.753040  0.672749  0.235551  1
  H  H637  1  0.753020  0.672790  0.568907  1
  H  H638  1  0.753044  0.672777  0.902319  1
  H  H639  1  0.752945  0.006740  0.235328  1
  H  H640  1  0.753010  0.006129  0.568870  1
  H  H641  1  0.753155  0.006251  0.902388  1
  H  H642  1  0.419706  0.339400  0.235500  1
  H  H643  1  0.419697  0.339415  0.568873  1
  H  H644  1  0.419737  0.339387  0.902290  1
  H  H645  1  0.086346  0.672786  0.235521  1
  H  H646  1  0.086332  0.672798  0.568883  1
  H  H647  1  0.086361  0.672841  0.902304  1
